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CS-W001157 4
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4,4'-(Benzo[c][1,2,5]thiadiazole-4,7-diyl)dibenzonitrile

  • CAS No. 867349-78-8

  • Cat. No. CS-0169879
  • Molecule weight338.39
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

4,4'-(Benzo[c][1,2,5]thiadiazole-4,7-diyl)dibenzonitrile|CS-0169879

Structure of 867349-78-8

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General Information

  • CAS No. 867349-78-8
  • Cat. No. CS-0169879
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₀H₁₀N₄S
  • Molecular Weight 338.39
  • Synonym(s) 4,7-Bis(4-cyanophenyl)-2,1,3-benzothiadiazole
  • SMILES N#CC1=CC=C(C2=CC=C(C3=CC=C(C=C3)C#N)C4=NSN=C42)C=C1

Synthesis

  • Route1

    References

    • DaSilveira Neto, Brenno A.; Lopes, Aline S.; Wuest, Martina; Costa, Valentim E. U.; Ebeling, Guenter; Dupont, Jairton Tetrahedron Letters, 2005 , vol. 46, # 40 p. 6843 - 6846
  • Route2

    References

    • Mancilha, Fabiana S.; DaSilveira Neto, Brenno A.; Lopes, Aline S.; Moreira Jr., Paulo F.; Quina, Frank H.; Goncalves, Reinaldo S.; Dupont, Jairton European Journal of Organic Chemistry, 2006 , # 21 p. 4924 - 4933
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    • 4,4'-(Benzo[c][1,2,5]thiadiazole-4,7-diyl)dibenzonitrile|CS-0169879
      867349-78-8

    References

    • Mancilha, Fabiana S.; DaSilveira Neto, Brenno A.; Lopes, Aline S.; Moreira Jr., Paulo F.; Quina, Frank H.; Goncalves, Reinaldo S.; Dupont, Jairton European Journal of Organic Chemistry, 2006 , # 21 p. 4924 - 4933

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P362+P364

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Computational Chemistry Data

  • TPSA   73.36
  • LogP   4.76866
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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